dimethyl 1-[(2-chlorophenyl)methyl]-4-(4-methyl-3-nitro-phenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 1-[(2-chlorophenyl)methyl]-4-(4-methyl-3-nitro-phenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 1-[(2-chlorophenyl)methyl]-4-(4-methyl-3-nitro-phenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-[(2-chlorophenyl)methyl]-4-(4-methyl-3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[(2-chlorophenyl)methyl]-4-(4-methyl-3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-(2-chlorobenzyl)-4-(4-methyl-3-nitro-phenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C23H21ClN2O6 MolecularWeight: 456.87564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2C(=CN(C=C2C(=O)OC)CC3=CC=CC=C3Cl)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2C(=CN(C=C2C(=O)OC)CC3=CC=CC=C3Cl)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H21ClN2O6/c1-14-8-9-15(10-20(14)26(29)30)21-17(22(27)31-2)12-25(13-18(21)23(28)32-3)11-16-6-4-5-7-19(16)24/h4-10,12-13,21H,11H2,1-3H3